3-(2-methoxyethoxy)-N-piperidin-4-yl-N-propylbenzamide

C18H28N2O3 — CID 119822999

IUPAC3-(2-methoxyethoxy)-N-piperidin-4-yl-N-propylbenzamide
SMILESCCCN(C(=O)c1cccc(OCCOC)c1)C1CCNCC1
InChIInChI=1S/C18H28N2O3/c1-3-11-20(16-7-9-19-10-8-16)18(21)15-5-4-6-17(14-15)23-13-12-22-2/h4-6,14,16,19H,3,7-13H2,1-2H3
InChIKeyGHYDDZAGCHIRIE-UHFFFAOYSA-N
MW320.43 g/mol
LogP2.32
Rot. Bonds8

About 3-(2-methoxyethoxy)-N-piperidin-4-yl-N-propylbenzamide

3-(2-methoxyethoxy)-N-piperidin-4-yl-N-propylbenzamide (PubChem CID 119822999) has the molecular formula C18H28N2O3 and a molecular weight of 320.43 g/mol. Its IUPAC name is 3-(2-methoxyethoxy)-N-piperidin-4-yl-N-propylbenzamide.

Molecular Properties

Compound Name3-(2-methoxyethoxy)-N-piperidin-4-yl-N-propylbenzamide
PubChem CID119822999
Molecular FormulaC18H28N2O3
Molecular Weight320.43 g/mol
Exact Mass320.21
IUPAC Name3-(2-methoxyethoxy)-N-piperidin-4-yl-N-propylbenzamide
SMILESCCCN(C(=O)c1cccc(OCCOC)c1)C1CCNCC1
InChIInChI=1S/C18H28N2O3/c1-3-11-20(16-7-9-19-10-8-16)18(21)15-5-4-6-17(14-15)23-13-12-22-2/h4-6,14,16,19H,3,7-13H2,1-2H3
InChIKeyGHYDDZAGCHIRIE-UHFFFAOYSA-N
XLogP2.32
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.43
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(3-methoxypropoxy)-N-propyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119530577
3-(2-methoxyethoxy)-N-methyl-N-piperidin-4-ylbenzamide
CID 119441131
3-(3-methoxypropoxy)-N-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119441938
3-methoxy-N-propyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119533031
3-[(3-methylphenyl)methoxy]-N-piperidin-4-yl-N-propylbenzamide
CID 119825677
3-cyano-N-piperidin-4-yl-N-propylbenzamide
CID 60806422
3-[piperidin-4-yl(propyl)carbamoyl]benzoic acid
CID 61408528
3-[(2-methyl-1,3-thiazol-4-yl)methoxy]-N-piperidin-4-yl-N-propylbenzamide
CID 119825259
N-cyclopropyl-N-(2-hydroxyethyl)-3-propoxybenzamide
CID 62920027
N-piperidin-4-yl-3,4-dipropoxy-N-propylbenzamide
CID 119825767
4-pentoxy-N-piperidin-4-yl-N-propylbenzamide
CID 119825577
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-piperidin-4-yl-N-propylbenzamide
CID 119824790

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethoxy)-N-piperidin-4-yl-N-propylbenzamide?
The IUPAC name of 3-(2-methoxyethoxy)-N-piperidin-4-yl-N-propylbenzamide (CID 119822999) is 3-(2-methoxyethoxy)-N-piperidin-4-yl-N-propylbenzamide.
What is the SMILES notation for 3-(2-methoxyethoxy)-N-piperidin-4-yl-N-propylbenzamide?
The canonical SMILES for 3-(2-methoxyethoxy)-N-piperidin-4-yl-N-propylbenzamide is CCCN(C(=O)c1cccc(OCCOC)c1)C1CCNCC1.
What is the InChIKey of 3-(2-methoxyethoxy)-N-piperidin-4-yl-N-propylbenzamide?
The InChIKey is GHYDDZAGCHIRIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O3/c1-3-11-20(16-7-9-19-10-8-16)18(21)15-5-4-6-17(14-15)23-13-12-22-2/h4-6,14,16,19H,3,7-13H2,1-2H3.
What are the key properties of 3-(2-methoxyethoxy)-N-piperidin-4-yl-N-propylbenzamide?
3-(2-methoxyethoxy)-N-piperidin-4-yl-N-propylbenzamide has a molecular weight of 320.43 g/mol, XLogP of 2.32, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethoxy)-N-piperidin-4-yl-N-propylbenzamide is sourced from PubChem (CID 119822999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).